HIT ID: HIT212038371
Cas No: 942398-84-7
分子式: C19H31ClF3NO3
分子量: 413.91
常用名: Amiselimod hydrochloride
氢键受体数 (HBA): 4
氢键供体数 (HBD): 3
LogP: 3.813358
IUPAC: 2-amino-2-{2-[4-(heptyloxy)-3-(trifluoromethyl)phenyl]ethyl}propane-1,3-diol hydrochloride
IUPAC: 2-amino-2-{2-[4-(heptyloxy)-3-(trifluoromethyl)phenyl]ethyl}propane-1,3-diol hydrochloride
SMILES: Cl.CCCCCCCOc1ccc(CCC(N)(CO)CO)cc1C(F)(F)F
SMILES: Cl.CCCCCCCOc1ccc(CCC(N)(CO)CO)cc1C(F)(F)F
InChI key: GEDVJGOVRLHFQG-UHFFFAOYSA-N
